Electron Spin Densities and Density Functional Approximations: Open-Shell Polycyclic Aromatic Hydrocarbons as Case Study

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Authors: Marika Savarese, Éric Brémond, Ilaria Ciofini, Carlo Adamo

Journal title: Journal of Chemical Theory and Computation

Journal number: 16/6

Journal publisher: American Chemical Society

Published year: 2020

Published pages: 3567-3577

DOI identifier: 10.1021/acs.jctc.0c00059

ISSN: 1549-9618